2-[(2-Fluoro-4-Iodophenyl)Amino]-5,5-Dimethyl-8-Oxo-N-[(3R)-3-Piperidinyl]-5,6,7,8-Tetrahydro-4H-Thieno[2,3-C]Azepine-3-Carboxamide
Properties
| Property | Value |
|---|---|
| Formula | C22H26FIN4O2S |
| IUPAC Name | 2-(2-fluoro-4-iodo-anilino)-5,5-dimethyl-8-oxo-n-[(3r)-3-piperidyl]-6,7-dihydro-4h-thieno[2,3-c]azepine-3-carboxamide |
| Molecular Mass | 556.435 g·mol−1 |
| Heat of Formation | -351.7 ± 16.7 kJ·mol−1 |
| Dipole Moment | 6.48 ± 1.08 D |
| Volume | 551.28 Å 3 |
| Surface Area | 448.39 Å 2 |
| HOMO Energy | -8.72 ± 0.55 eV |
| LUMO Energy | 1.79 ± eV |
| Point Group Symmetry | C1 |
| InChIKey | YSSBOOQPHTZACI-CYBMUJFWSA-N |
| QR Code | Generate QR Code |
| Links | PubChem ChemSpider |
| DOI | |
| Downloads | Get JSON data Get MOL2 data Get SVG Image |
| Elements | C F I H O N S |